Glycoside
GD003332
Name:
NoneFormula:
C16H17O5N3Smiles:
OC[C@H](O)[C@H](O)[C@H](O)c1c[nH]c(-c2cc(-c3ccccc3)on2)n1Aglycone:
c1ccc(-c2cc(-c3ncc[nH]3)no2)cc1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 6 |
| MolWt: | 331.33 | Num_heavy_atoms: | 24 |
| TPSA: | 135.63 | NumAromaticRings: | 3 |
Unique Aglycone
AD03035
Formula: C12H9ON3
Smiles:
c1ccc(-c2cc(-c3ncc[nH]3)no2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.73 | Num_rotatable_bonds: | 2 |
| MolWt: | 211.22 | Num_heavy_atoms: | 16 |
| TPSA: | 54.71 | NumAromaticRings: | 3 |
